Dataset
high resolution fast-atom bombardment mass spectrometry (HRFABMS)
Chemical Info
InChI | InChI=1S/C17H17N5/c1-17(2,3)21-15-12-7-5-4-6-11(12)14-16(20-15)22-9-8-18-10-13(22)19-14/h4-10H,1-3H3,(H,20,21) |
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SMILES | CC(Nc1nc2c(c3c1cccc3)nc1n2ccnc1)(C)C |
InChI Key | UDIATBZHGYLNCJ-UHFFFAOYSA-N |
Molecular Formula | C17H17N5 |
Exact Mass | 291.350 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/UDIATBZHGYLNCJ-UHFFFAOYSA-N/CHMO0000726 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/UDIATBZHGYLNCJ-UHFFFAOYSA-N/CHMO0000726 |
Version | |
Author | Mareen Stahlberger |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T08:18:13.071826 |
MetadataModified | 2024-09-08T00:16:05.598176 |
MetadataPublished | 2023-01-23 |
Field | Value |
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Measurement Technique | high resolution fast-atom bombardment mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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166451848 | PubChem |
The data in this table is sourced from UniChem at EBI. |